Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ao2_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 4.A N SER 1.A O no hydrogen 3.329 N/A TRP 5.A N THR 56.A O no hydrogen 2.988 N/A GLN 6.A N VAL 21.A O no hydrogen 2.860 N/A LEU 7.A N HIS 58.A O no hydrogen 2.807 N/A ASP 8.A N VAL 19.A O no hydrogen 2.909 N/A CYS 9.A SG GLU 36.A OE1 no hydrogen 3.499 N/A CYS 9.A SG GLU 36.A OE2 no hydrogen 3.734 N/A CYS 9.A SG ASP 60.A OD2 no hydrogen 3.849 N/A THR 10.A N ILE 17.A O no hydrogen 2.803 N/A THR 10.A OG1 ASN 86.A OD1 no hydrogen 2.458 N/A LEU 12.A N LYS 15.A O no hydrogen 3.158 N/A LYS 15.A N LEU 12.A O no hydrogen 2.783 N/A ILE 17.A N THR 10.A O no hydrogen 2.804 N/A LEU 18.A N GLU 31.A O no hydrogen 2.991 N/A VAL 19.A N ASP 8.A O no hydrogen 2.796 N/A ALA 20.A N GLU 29.A O no hydrogen 2.731 N/A VAL 21.A N GLN 6.A O no hydrogen 2.806 N/A HIS 22.A N TYR 27.A O no hydrogen 2.803 N/A HIS 22.A ND1 SER 25.A OG no hydrogen 2.754 N/A HIS 22.A NE2 PRO 2.A O no hydrogen 2.639 N/A VAL 23.A N ILE 4.A O no hydrogen 3.176 N/A SER 25.A N HIS 22.A O no hydrogen 3.126 N/A SER 25.A OG HIS 22.A ND1 no hydrogen 2.754 N/A SER 25.A OG HIS 22.A O no hydrogen 3.436 N/A GLY 26.A N HIS 22.A O no hydrogen 2.794 N/A TYR 27.A N SER 25.A OG no hydrogen 3.084 N/A TYR 27.A OH GLU 29.A OE2 no hydrogen 3.391 N/A ILE 28.A N ASN 115.A OD1 no hydrogen 2.979 N/A GLU 29.A N ALA 20.A O no hydrogen 2.964 N/A GLU 31.A N LEU 18.A O no hydrogen 3.100 N/A ILE 33.A N VAL 16.A O no hydrogen 2.840 N/A THR 37.A N ALA 35.A O no hydrogen 2.879 N/A GLU 40.A N THR 37.A OG1 no hydrogen 3.277 N/A THR 41.A N THR 37.A O no hydrogen 2.909 N/A THR 41.A OG1 THR 37.A O no hydrogen 2.794 N/A ALA 42.A N GLY 38.A O no hydrogen 2.794 N/A TYR 43.A N GLN 39.A O no hydrogen 3.073 N/A PHE 44.A N GLU 40.A O no hydrogen 3.010 N/A LEU 45.A N THR 41.A O no hydrogen 2.958 N/A LEU 46.A N ALA 42.A O no hydrogen 2.877 N/A LYS 47.A N TYR 43.A O no hydrogen 2.977 N/A LYS 47.A NZ GLU 31.A OE2 no hydrogen 2.967 N/A LEU 48.A N PHE 44.A O no hydrogen 2.890 N/A ALA 49.A N LEU 45.A O no hydrogen 2.887 N/A GLY 50.A N LEU 46.A O no hydrogen 3.169 N/A GLY 50.A N LYS 47.A O no hydrogen 3.219 N/A ARG 51.A N LEU 48.A O no hydrogen 3.053 N/A ARG 51.A NH1 LYS 47.A O no hydrogen 2.891 N/A TRP 52.A N LEU 48.A O no hydrogen 3.164 N/A TRP 52.A NE1 GLU 29.A OE2 no hydrogen 2.930 N/A LYS 55.A N GLY 3.A O no hydrogen 2.843 N/A THR 56.A N GLY 3.A O no hydrogen 3.183 N/A VAL 57.A N LYS 80.A O no hydrogen 2.957 N/A HIS 58.A N TRP 5.A O no hydrogen 2.771 N/A HIS 58.A ND1 GLU 82.A O no hydrogen 2.605 N/A THR 59.A OG1 GLN 81.A OE1 no hydrogen 2.989 N/A ASN 61.A N THR 59.A OG1 no hydrogen 2.938 N/A GLY 62.A N ASP 60.A OD1 no hydrogen 2.883 N/A ASN 64.A ND2 THR 41.A OG1 no hydrogen 2.884 N/A PHE 65.A N GLY 62.A O no hydrogen 2.828 N/A THR 66.A N SER 63.A O no hydrogen 3.283 N/A THR 66.A OG1 SER 63.A O no hydrogen 2.838 N/A ARG 71.A N GLY 67.A O no hydrogen 3.424 N/A ALA 72.A N ALA 68.A O no hydrogen 2.836 N/A ALA 73.A N THR 69.A O no hydrogen 2.959 N/A CYS 74.A N VAL 70.A O no hydrogen 2.966 N/A CYS 74.A SG VAL 70.A O no hydrogen 3.386 N/A ASP 75.A N ARG 71.A O no hydrogen 3.005 N/A TRP 76.A N ALA 72.A O no hydrogen 2.951 N/A ALA 77.A N ALA 73.A O no hydrogen 2.903 N/A GLY 78.A N ASP 75.A O no hydrogen 3.083 N/A ILE 79.A N CYS 74.A O no hydrogen 2.794 N/A LYS 80.A N LYS 55.A O no hydrogen 2.951 N/A LYS 87.A N GLU 83.A O no hydrogen 3.304 N/A GLU 88.A N SER 84.A O no hydrogen 2.792 N/A LEU 89.A N MET 85.A O no hydrogen 2.765 N/A LYS 90.A N ASN 86.A O no hydrogen 3.011 N/A LYS 91.A N LYS 87.A O no hydrogen 2.870 N/A ILE 92.A N GLU 88.A O no hydrogen 2.906 N/A ILE 93.A N LEU 89.A O no hydrogen 2.907 N/A GLY 94.A N LYS 90.A O no hydrogen 2.932 N/A GLN 95.A N LYS 91.A O no hydrogen 2.981 N/A VAL 96.A N ILE 92.A O no hydrogen 3.007 N/A VAL 96.A N ILE 93.A O no hydrogen 3.111 N/A ARG 97.A N GLY 94.A O no hydrogen 3.437 N/A ARG 97.A NE GLU 13.A OE1 no hydrogen 2.615 N/A ARG 97.A NE GLU 13.A OE2 no hydrogen 3.376 N/A ARG 97.A NH1 ARG 97.A O no hydrogen 2.908 N/A ARG 97.A NH1 ALA 100.A O no hydrogen 2.911 N/A ARG 97.A NH2 GLU 13.A OE2 no hydrogen 3.174 N/A ARG 97.A NH2 GLU 101.A O no hydrogen 3.406 N/A GLN 99.A N VAL 96.A O no hydrogen 2.945 N/A ALA 100.A N ARG 97.A O no hydrogen 3.391 N/A THR 105.A N HIS 102.A O no hydrogen 3.149 N/A ALA 106.A N HIS 102.A O no hydrogen 3.339 N/A VAL 107.A N LEU 103.A O no hydrogen 2.836 N/A GLN 108.A N LYS 104.A O no hydrogen 3.144 N/A GLN 108.A NE2 ALA 30.A O no hydrogen 2.900 N/A MET 109.A N THR 105.A O no hydrogen 2.920 N/A ALA 110.A N ALA 106.A O no hydrogen 2.998 N/A VAL 111.A N VAL 107.A O no hydrogen 2.878 N/A PHE 112.A N GLN 108.A O no hydrogen 3.003 N/A ILE 113.A N MET 109.A O no hydrogen 2.906 N/A HIS 114.A N ALA 110.A O no hydrogen 2.867 N/A HIS 114.A ND1 GLU 88.A OE1 no hydrogen 2.799 N/A HIS 114.A NE2 GLY 26.A O no hydrogen 2.641 N/A ASN 115.A N VAL 111.A O no hydrogen 2.970 N/A ASN 115.A ND2 ILE 28.A O no hydrogen 2.912 N/A HIS 116.A N PHE 112.A O no hydrogen 3.045 N/A HIS 116.A N ILE 113.A O no hydrogen 3.296 N/A HIS 116.A ND1 PHE 112.A O no hydrogen 2.875 N/A LYS 117.A N ILE 113.A O no hydrogen 2.891 N/A ARG 118.A NH1 GLY 122.A O no hydrogen 2.584 N/A GLY 122.A N GLY 120.A O no hydrogen 2.772 N/A SER 124.A N GLU 127.A OE1 no hydrogen 2.737 N/A SER 124.A OG ASN 115.A O no hydrogen 3.488 N/A SER 124.A OG GLU 127.A OE1 no hydrogen 3.316 N/A GLY 126.A N ASN 115.A O no hydrogen 3.009 N/A GLU 127.A N SER 124.A OG no hydrogen 3.110 N/A ARG 128.A N SER 124.A O no hydrogen 2.936 N/A ARG 128.A NE SER 25.A O no hydrogen 2.889 N/A ARG 128.A NH2 SER 25.A O no hydrogen 2.931 N/A ILE 129.A N ALA 125.A O no hydrogen 2.954 N/A VAL 130.A N GLY 126.A O no hydrogen 3.387 N/A ASP 131.A N GLU 127.A O no hydrogen 2.976 N/A ILE 132.A N ARG 128.A O no hydrogen 2.930 N/A ILE 133.A N ILE 129.A O no hydrogen 3.043 N/A ALA 134.A N VAL 130.A O no hydrogen 2.884 N/A THR 135.A N ASP 131.A O no hydrogen 3.004 N/A THR 135.A OG1 ASP 131.A O no hydrogen 2.646 N/A ASP 136.A N ILE 132.A O no hydrogen 3.058 N/A ILE 137.A N ILE 133.A O no hydrogen 3.072 N/A GLN 138.A N ALA 134.A O no hydrogen 2.993 N/A